CID 207709

30533-86-9

Structural Information

Molecular Formula
C14H16N2O3
SMILES
C#CCOC1=C(C=C(C=C1)N)C(=O)N2CCOCC2
InChI
InChI=1S/C14H16N2O3/c1-2-7-19-13-4-3-11(15)10-12(13)14(17)16-5-8-18-9-6-16/h1,3-4,10H,5-9,15H2
InChIKey
RWQJFPLSEUUFFS-UHFFFAOYSA-N
Compound name
(5-amino-2-prop-2-ynoxyphenyl)-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.1161 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.12338 162.9
[M+Na]+ 283.10532 173.6
[M+NH4]+ 278.14992 166.0
[M+K]+ 299.07926 165.2
[M-H]- 259.10882 158.4
[M+Na-2H]- 281.09077 164.6
[M]+ 260.11555 162.1
[M]- 260.11665 162.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.